[gmx-users] BUG: gromacs-REMD implementation

Berk Hess gmx3 at hotmail.com
Thu Feb 24 08:55:27 CET 2005



>From: Walter Ash <wlash at ucalgary.ca>
>Reply-To: Discussion list for GROMACS users <gmx-users at gromacs.org>
>To: gmx-users at gromacs.org, gmx-developers at gromacs.org
>Subject: [gmx-users] BUG: gromacs-REMD implementation
>Date: Wed, 23 Feb 2005 23:51:21 -0700
>
>Incidentally, the bug I was referring to applies to the gromacs REMD 
>implementation that was available on my website at 
>http://moose.bio.ucalgary.ca/People/Walter - just in case there are other 
>implementations floating around.

The CVS version of Gromacs has replica exchange.
But this is a completely independent implementation by me.
This will be in the 3.3 release.

Berk.

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